Cas no 80811-66-1 (5,12[1',2']:6,11[1'',2'']-Dibenzenocycloocta[1,2-b:5,6-b']dipyridine,5,6,11,12-tetrahydro- (9CI))

5,12[1',2']:6,11[1'',2'']-Dibenzenocycloocta[1,2-b:5,6-b']dipyridine,5,6,11,12-tetrahydro- (9CI) structure
80811-66-1 structure
Product Name:5,12[1',2']:6,11[1'',2'']-Dibenzenocycloocta[1,2-b:5,6-b']dipyridine,5,6,11,12-tetrahydro- (9CI)
CAS No:80811-66-1
MF:C26H18N2
MW:358.434525966644
CID:727744
PubChem ID:144927
Update Time:2025-04-19

5,12[1',2']:6,11[1'',2'']-Dibenzenocycloocta[1,2-b:5,6-b']dipyridine,5,6,11,12-tetrahydro- (9CI) Chemical and Physical Properties

Names and Identifiers

    • 5,12[1',2']:6,11[1'',2'']-Dibenzenocycloocta[1,2-b:5,6-b']dipyridine,5,6,11,12-tetrahydro- (9CI)
    • Benzo(g)isoquinoline dimer
    • Benzo[g]isoquinoline dimer
    • 80811-66-1
    • Inchi: 1S/C26H18N2/c1-3-7-17-15(5-1)23-19-9-11-27-13-21(19)25(17)26-18-8-4-2-6-16(18)24(23)20-10-12-28-14-22(20)26/h1-14,23-26H
    • InChI Key: ACMQEIHJCHAYKT-UHFFFAOYSA-N
    • SMILES: N1C=CC2=C(C=1)C1C3C=CC=CC=3C2C2C3C=CN=CC=3C1C1C=CC=CC2=1

Computed Properties

  • Exact Mass: 358.146998583g/mol
  • Monoisotopic Mass: 358.146998583g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 28
  • Rotatable Bond Count: 0
  • Complexity: 551
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 4
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 4.3
  • Topological Polar Surface Area: 25.8?2
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